![2-[[(Z)-2-nitroethenyl]amino]benzoic acid structure](/static/products/1529/152904-43-3.webp)
2-[[(Z)-2-nitroethenyl]amino]benzoic acid
TL;DR: 2-[[(Z)-2-nitroethenyl]amino]benzoic acid (CAS 152904-43-3) is a chemical compound with molecular formula C9H8N2O4 and molecular weight 208.0484 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[[(Z)-2-nitroethenyl]amino]benzoic acid
Also Known As: 2-[[(Z)-2-nitroethenyl]amino]benzoic acid, 2-{[(Z)-2-nitrovinyl]amino}benzoic acid, 2-[((1Z)-2-nitrovinyl)amino]benzoic acid, 2-{[(Z)-2-nitroethenyl]amino}benzoic acid, Benzoic acid, 2-[(2-nitroethenyl)amino]-, (Z)- (9CI)
Technical Specifications
| Molecular Formula | C9H8N2O4 |
| Molecular Weight | 208.0484 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 95.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 208.0484 Da |
| Heavy Atoms | 15 |
| Complexity | 272.0 |
| SMILES | C1=CC=C(C(=C1)C(=O)O)N/C=C\[N+](=O)[O-] |
| InChIKey | YWPFGPVRLBUCRW-WAYWQWQTSA-N |
Chemical Property Profile of 2-[[(Z)-2-nitroethenyl]amino]benzoic acid
Property Insights of 2-[[(Z)-2-nitroethenyl]amino]benzoic acid
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[[(Z)-2-nitroethenyl]amino]benzoic acid. The TPSA of 95.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[[(Z)-2-nitroethenyl]amino]benzoic acid. Following Lipinski's Rule of Five, 2-[[(Z)-2-nitroethenyl]amino]benzoic acid has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-[[(Z)-2-nitroethenyl]amino]benzoic acid?
The CAS number of 2-[[(Z)-2-nitroethenyl]amino]benzoic acid is 152904-43-3.
What is the molecular formula of 2-[[(Z)-2-nitroethenyl]amino]benzoic acid?
The molecular formula of 2-[[(Z)-2-nitroethenyl]amino]benzoic acid is C9H8N2O4.
What is the molecular weight of 2-[[(Z)-2-nitroethenyl]amino]benzoic acid?
The molecular weight of 2-[[(Z)-2-nitroethenyl]amino]benzoic acid is 208.0484 g/mol.
Where can I buy 2-[[(Z)-2-nitroethenyl]amino]benzoic acid?
You can request a quote for 2-[[(Z)-2-nitroethenyl]amino]benzoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-[[(Z)-2-nitroethenyl]amino]benzoic acid?
Yes, CoreyChem provides custom synthesis services for 2-[[(Z)-2-nitroethenyl]amino]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.